CID 58091543

5-amino-n,n-dimethyl-1,3,4-thiadiazole-2-carboxamide

Structural Information

Molecular Formula
C5H8N4OS
SMILES
CN(C)C(=O)C1=NN=C(S1)N
InChI
InChI=1S/C5H8N4OS/c1-9(2)4(10)3-7-8-5(6)11-3/h1-2H3,(H2,6,8)
InChIKey
BLQZBVCYJPMNDV-UHFFFAOYSA-N
Compound name
5-amino-N,N-dimethyl-1,3,4-thiadiazole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

172.04189 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.049166 134.0
[M+Na]+ 195.031108 142.8
[M-H]- 171.034614 136.9
[M+NH4]+ 190.075713 154.0
[M+K]+ 211.005048 142.1
[M+H-H2O]+ 155.039150 126.7
[M+HCOO]- 217.040091 153.9
[M+CH3COO]- 231.055741 183.5
[M+Na-2H]- 193.016556 135.8
[M]+ 172.04134142 135.5
[M]- 172.04243858 135.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe